[(E)-4-(4-methylphenyl)sulfonyl-4-methylsulfanyl-but-3-en-2-yl] ethanoate

Systemtic Name: [(E)-4-(4-methylphenyl)sulfonyl-4-methylsulfanyl-but-3-en-2-yl] ethanoate Openeye Name: [(E)-1-methyl-3-methylsulfanyl-3-(p-tolylsulfonyl)allyl] acetate CAS Name: acetic acid [(E)-4-(4-methylphenyl)sulfonyl-4-(methylthio)but-3-en-2-yl] ester IUPAC Name: [(E)-4-(4-methylphenyl)sulfonyl-4-methylsulfanylbut-3-en-2-yl] acetate Traditional Name: acetic acid [(E)-1-methyl-3-(methylthio)-3-tosyl-allyl] ester Formula: C14H18O4S2 MolecularWeight: 314.42032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(=CC(C)OC(=O)C)SC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/C(=C/C(C)OC(=O)C)/SC

InChI

InChI=1S/C14H18O4S2/c1-10-5-7-13(8-6-10)20(16,17)14(19-4)9-11(2)18-12(3)15/h5-9,11H,1-4H3/b14-9+